(6aS)-8-ethenyl-3-methyl-4-phenylmethoxy-6a,9-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione

Systemtic Name: (6aS)-8-ethenyl-3-methyl-4-phenylmethoxy-6a,9-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione Openeye Name: (6aS)-4-benzyloxy-3-methyl-8-vinyl-6a,9-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione CAS Name: (6aS)-8-ethenyl-3-methyl-4-phenylmethoxy-6a,9-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione IUPAC Name: (6aS)-8-ethenyl-3-methyl-4-phenylmethoxy-6a,9-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione Traditional Name: (6aS)-4-benzoxy-3-methyl-8-vinyl-6a,9-dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-quinone Formula: C22H20N2O3 MolecularWeight: 360.4058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=O)N3CC(=CC3C(=O)N2)C=C)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=O)N3CC(=C[C@H]3C(=O)N2)C=C)OCC4=CC=CC=C4

InChI

InChI=1S/C22H20N2O3/c1-3-15-11-18-21(25)23-19-17(22(26)24(18)12-15)10-9-14(2)20(19)27-13-16-7-5-4-6-8-16/h3-11,18H,1,12-13H2,2H3,(H,23,25)/t18-/m0/s1